3-Nitro-4'-fluorochalcone
TL;DR: 3-Nitro-4'-fluorochalcone (CAS 1089286-32-7) is a chemical compound with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-fluorophenyl)-3-(3-nitrophenyl)prop-2-en-1-one
Also Known As: 3-Nitro-4'-fluorochalcone, 2-Butyl-2-adamantanol, 3-Nitro-4 -fluorochalcone, (E)-1-(4-fluorophenyl)-3-(3-nitrophenyl)prop-2-en-1-one, 1-(4-fluorophenyl)-3-(3-nitrophenyl)prop-2-en-1-one
| Molecular Formula | C15H10FNO3 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 3.63 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.06448 |
| Heavy Atoms | 20 |
| Complexity | 677.7729 |
Chemical Identifiers
| CAS Number | 1089286-32-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)C2=CC=C(C=C2)F |
Product Overview
3-Nitro-4'-fluorochalcone (CAS 1089286-32-7), with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol. IUPAC: (E)-1-(4-fluorophenyl)-3-(3-nitrophenyl)prop-2-en-1-one.
Chemical Property Profile of 3-Nitro-4'-fluorochalcone
Property Insights of 3-Nitro-4'-fluorochalcone
The XLogP value of 3.63 indicates that 3-Nitro-4'-fluorochalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-4'-fluorochalcone. Following Lipinski's Rule of Five, 3-Nitro-4'-fluorochalcone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Nitro-4'-fluorochalcone?
The CAS number of 3-Nitro-4'-fluorochalcone is 1089286-32-7.
What is the molecular formula of 3-Nitro-4'-fluorochalcone?
The molecular formula of 3-Nitro-4'-fluorochalcone is C15H10FNO3.
What is the molecular weight of 3-Nitro-4'-fluorochalcone?
The molecular weight of 3-Nitro-4'-fluorochalcone is 271.06 g/mol.
Where can I buy 3-Nitro-4'-fluorochalcone?
You can request a quote for 3-Nitro-4'-fluorochalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-4'-fluorochalcone?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-4'-fluorochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.